1,1-bis(2,2,6,6-tetramethylpiperidin-4-yl)hexane-1,6-diamine

C24H50N4 — CID 18356383

IUPAC1,1-bis(2,2,6,6-tetramethylpiperidin-4-yl)hexane-1,6-diamine
SMILESCC1(C)CC(C(N)(CCCCCN)C2CC(C)(C)NC(C)(C)C2)CC(C)(C)N1
InChIInChI=1S/C24H50N4/c1-20(2)14-18(15-21(3,4)27-20)24(26,12-10-9-11-13-25)19-16-22(5,6)28-23(7,8)17-19/h18-19,27-28H,9-17,25-26H2,1-8H3
InChIKeyXUPYLULUBUOSTF-UHFFFAOYSA-N
MW394.69 g/mol
LogP4.32
Rot. Bonds7

About 1,1-bis(2,2,6,6-tetramethylpiperidin-4-yl)hexane-1,6-diamine

1,1-bis(2,2,6,6-tetramethylpiperidin-4-yl)hexane-1,6-diamine (PubChem CID 18356383) has the molecular formula C24H50N4 and a molecular weight of 394.69 g/mol. Its IUPAC name is 1,1-bis(2,2,6,6-tetramethylpiperidin-4-yl)hexane-1,6-diamine.

Molecular Properties

Compound Name1,1-bis(2,2,6,6-tetramethylpiperidin-4-yl)hexane-1,6-diamine
PubChem CID18356383
Molecular FormulaC24H50N4
Molecular Weight394.69 g/mol
Exact Mass394.40
IUPAC Name1,1-bis(2,2,6,6-tetramethylpiperidin-4-yl)hexane-1,6-diamine
SMILESCC1(C)CC(C(N)(CCCCCN)C2CC(C)(C)NC(C)(C)C2)CC(C)(C)N1
InChIInChI=1S/C24H50N4/c1-20(2)14-18(15-21(3,4)27-20)24(26,12-10-9-11-13-25)19-16-22(5,6)28-23(7,8)17-19/h18-19,27-28H,9-17,25-26H2,1-8H3
InChIKeyXUPYLULUBUOSTF-UHFFFAOYSA-N
XLogP4.32
TPSA76.10 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500394.69
LogP ≤ 54.32
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

1,6-Bis(2,2,6,6-tetramethyl-4-piperidylamino)hexane
CID 93419
1-Methyl-1-pentadecyl-4-piperidin-4-ylpiperidin-1-ium chloride
CID 11568143
1-Heptyl-4-piperidin-4-ylpiperidine
CID 44592883
1-Nonyl-4-piperidin-4-ylpiperidine
CID 44592884
N-[(3-fluoropiperidin-4-yl)methyl]-1-[4-fluoro-4-[(propan-2-ylamino)methyl]piperidin-2-yl]propan-2-amine
CID 132012443
4-(2,5-Dimethyl-5-piperidin-4-ylhexan-2-yl)-4-fluoropiperidine
CID 137508376
(10R,14S)-4-fluoro-10-methyl-5,8,16-triazatricyclo[13.3.1.02,7]nonadecan-14-amine
CID 141456619
2-[3-(3,3-Difluoro-1-methylpiperidin-4-yl)butyl]-2,6,6-trimethyl-4-propan-2-ylpiperidine
CID 170386786
Bis-(1,2,5-trimethyl-4-piperidyl)methylamine
CID 129779312
1,4-Di-(2,2,6,6-tetramethyl-4-piperidyl)butane
CID 129809890
1-Tridecyl-[4,4'']bipiperidinyl; dihydrochloride
CID 11553599
1-Pentadecyl-[4,4'']bipiperidinyl; dihydrochloride
CID 11561507

Frequently Asked Questions

What is the IUPAC name of 1,1-bis(2,2,6,6-tetramethylpiperidin-4-yl)hexane-1,6-diamine?
The IUPAC name of 1,1-bis(2,2,6,6-tetramethylpiperidin-4-yl)hexane-1,6-diamine (CID 18356383) is 1,1-bis(2,2,6,6-tetramethylpiperidin-4-yl)hexane-1,6-diamine.
What is the SMILES notation for 1,1-bis(2,2,6,6-tetramethylpiperidin-4-yl)hexane-1,6-diamine?
The canonical SMILES for 1,1-bis(2,2,6,6-tetramethylpiperidin-4-yl)hexane-1,6-diamine is CC1(C)CC(C(N)(CCCCCN)C2CC(C)(C)NC(C)(C)C2)CC(C)(C)N1.
What is the InChIKey of 1,1-bis(2,2,6,6-tetramethylpiperidin-4-yl)hexane-1,6-diamine?
The InChIKey is XUPYLULUBUOSTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H50N4/c1-20(2)14-18(15-21(3,4)27-20)24(26,12-10-9-11-13-25)19-16-22(5,6)28-23(7,8)17-19/h18-19,27-28H,9-17,25-26H2,1-8H3.
What are the key properties of 1,1-bis(2,2,6,6-tetramethylpiperidin-4-yl)hexane-1,6-diamine?
1,1-bis(2,2,6,6-tetramethylpiperidin-4-yl)hexane-1,6-diamine has a molecular weight of 394.69 g/mol, XLogP of 4.32, 7 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1-bis(2,2,6,6-tetramethylpiperidin-4-yl)hexane-1,6-diamine is sourced from PubChem (CID 18356383), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).